N-(3-imidazol-1-ylpropyl)-2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine CAS Name: N-[3-(1-imidazolyl)propyl]-2-methyl-6-[3-(trifluoromethyl)phenyl]-4-pyrimidinamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine Traditional Name: 3-imidazol-1-ylpropyl-[2-methyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amine Formula: C18H18F3N5 MolecularWeight: 361.36423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NCCCN2C=CN=C2)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=NC(=CC(=N1)NCCCN2C=CN=C2)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N5/c1-13-24-16(14-4-2-5-15(10-14)18(19,20)21)11-17(25-13)23-6-3-8-26-9-7-22-12-26/h2,4-5,7,9-12H,3,6,8H2,1H3,(H,23,24,25)